5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(1-butylindolin-5-yl)methylene]-1-phenethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(1-butylindolin-5-yl)methylene]-1-phenethyl-barbituric acid Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3/c1-2-3-13-27-14-12-20-16-19(9-10-22(20)27)17-21-23(29)26-25(31)28(24(21)30)15-11-18-7-5-4-6-8-18/h4-10,16-17H,2-3,11-15H2,1H3,(H,26,29,31)